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CHEBI:139868 - bkas#28

Default Structure
ChEBI IDCHEBI:139868
ChEBI Namebkas#28
Stars
SubmitterMichael Witting
DownloadsMolfile
FormulaC22H40O7
Net Charge0
Average Mass416.555
Monoisotopic Mass416.27740
SMILESC[C@H](CCCCCCCCCCCC(=O)CC(=O)O)O[C@@H]1O[C@@H](C)[C@H](O)C[C@H]1O
InChIInChI=1S/C22H40O7/c1-16(28-22-20(25)15-19(24)17(2)29-22)12-10-8-6-4-3-5-7-9-11-13-18(23)14-21(26)27/h16-17,19-20,22,24-25H,3-15H2,1-2H3,(H,26,27)/t16-,17+,19-,20-,22-/m1/s1
InChIKeyRYEGSQBSXWUUPK-HTJFHPCASA-N
ChEBI Ontology
Outgoing Relation(s)
bkas#28 (CHEBI:139868) is a organic molecular entity (CHEBI:50860)